EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:215579 - Thiocladospolide H

ChEBI IDCHEBI:215579
ChEBI NameThiocladospolide H
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O6S
Net Charge0
Average Mass332.418
Monoisotopic Mass332.12936
SMILESC[C@@H]1CCCCCCC(=O)C[C@H](SC[C@@H](O)C(=O)O)C(=O)O1
InChIInChI=1S/C15H24O6S/c1-10-6-4-2-3-5-7-11(16)8-13(15(20)21-10)22-9-12(17)14(18)19/h10,12-13,17H,2-9H2,1H3,(H,18,19)/t10-,12-,13+/m1/s1
InChIKeySNYHQBOFQSOLPL-RTXFEEFZSA-N
Species of MetaboliteComponentSourceComments
Cladosporium (ncbitaxon:5498) - PubMed (32888671)
ChEBI Ontology
Outgoing Relation(s)
Thiocladospolide H (CHEBI:215579) is a macrolide (CHEBI:25106)
IUPAC Name 
(2S)-2-hydroxy-3-[[(3S,12R)-12-methyl-2,5-dioxo-oxacyclododec-3-yl]sulanyl]propanoic acid
Manual XrefsDatabases
101936539ChemSpider